Citation:

PANGAEA.973812

Name: Dissolved rare earth elements, shale-normalized patterns, biogeochemical parameters, and indices from molecular analysis of dissolved organic matter across the land-ocean continuum in the German Bight
Published: 2025-06-16
License: https://creativecommons.org/licenses/by/4.0/
Keywords: Anthropogenic REE; coastal transition zones; Dissolved Organic Matter; German Bight; Rare earth elements; Southern North Sea; tidal flats; Wadden Sea

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Published: 2025-06-16 • DOI registered: 2025-06-16

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Abstract:

We analyzed concentrations of dissolved rare earth elements (REE) across the land-ocean continuum in the German Bight (southern North Sea) to identify key drivers for REE cycling in dynamic coastal environments. We identified the coastal transition zone as a critical interface for altering predominantly riverine-derived natural and anthropogenic REEs. We combined shale-normalized REE patterns, measured by quadrupole inductively coupled plasma-mass spectrometry (Q-ICP-MS), with biogeochemical bulk parameters and molecular analysis of dissolved organic matter (DOM) determined by ultrahigh-resolution mass spectrometry (FT-ICR-MS). Samples were acquired during RV Heincke cruise HE527. The dataset includes spatially resolved biogeochemical data (concentrations of chlorophyll-a, dissolved nitrogen, dissolved organic carbon, suspended particulate matter, dissolved iron, dissolved manganese and dissolved REE) in surface waters obtained along the major estuarine transects (Ems, Weser, and Elbe), coast-orthogonal transects and an offshore North Sea transect, with additional deep-water samples. Temporally resolved data were collected near the barrier islands Langeoog and Spiekeroog including the Otzumer Balje inlet. The dataset also contains molecular indices based on DOM composition (see Speidel et al., 2024) REE subgroups, ratios and concentrations of anthropogenic Samarium and Gadolinium (for details see Mori et al., 2025).

Keyword(s):

Anthropogenic REE; coastal transition zones; Dissolved Organic Matter; German Bight; Rare earth elements; Southern North Sea; tidal flats; Wadden Sea

Supplement to:

Mori, Corinna; Dellwig, Olaf; Wollschläger, Jochen; Seidel, Michael (2025): Process zone specific alteration of rare earth element (REE) patterns across the land–ocean transition of the southern North Sea. Geochimica et Cosmochimica Acta, 402, 32-48, https://doi.org/10.1016/j.gca.2025.06.017

Related to:

Speidel, Linn; Carvalho da Silva, Roger; Beck, Melanie; Dellwig, Olaf; Wollschläger, Jochen; Dittmar, Thorsten; Seidel, Michael (2024): Rivers and tidal flats as sources of dissolved organic matter and trace metals in the German Bight (North Sea). Biogeochemistry, 167(3), 225-250, https://doi.org/10.1007/s10533-024-01117-3

Funding:

Deutsche Forschungsgemeinschaft, Bonn (DFG), grant/award no. DI 842/6-1 : marDOS – Are permeable coastal sediments hotspots for the formation of non-volatile dissolved organic sulfur (DOS) in the ocean?

German Research Foundation (DFG), grant/award no. 390741603 : EXC 2077: The Ocean Floor – Earth's Uncharted Interface

Coverage:

Median Latitude: 54.075992 * Median Longitude: 7.367731 * South-bound Latitude: 53.340700 * West-bound Longitude: 4.482283 * North-bound Latitude: 55.397000 * East-bound Longitude: 9.000917

Date/Time Start: 2019-03-19T09:45:00 * Date/Time End: 2019-03-31T03:57:00

Minimum DEPTH, water: 3.6 m * Maximum DEPTH, water: 33.5 m

Event(s):

HE527_1-1 * Latitude: 53.518900 * Longitude: 8.553800 * Date/Time: 2019-03-19T09:22:00 * Elevation: -10.0 m * Campaign: (PLASTIC & LIGHT: North Sea) * Basis: * Method/Device: (CTD-RO)

HE527_2-1 * Latitude: 53.718400 * Longitude: 8.270700 * Date/Time: 2019-03-19T11:54:00 * Elevation: -10.0 m * Campaign: (PLASTIC & LIGHT: North Sea) * Basis: * Method/Device: (CTD-RO)

HE527_3-1 * Latitude: 53.781900 * Longitude: 8.143600 * Date/Time: 2019-03-19T13:21:00 * Elevation: -20.0 m * Campaign: (PLASTIC & LIGHT: North Sea) * Basis: * Method/Device: (CTD-RO)

Parameter(s):

#	Name	Short Name	Unit	Principal Investigator	Method/Device	Comment
1	Event label	Event		Seidel, Michael
2	Station label	Station		Mori, Corinna
3	DATE/TIME	Date/Time		Seidel, Michael		Geocode
4	LATITUDE	Latitude		Seidel, Michael		Geocode
5	LONGITUDE	Longitude		Seidel, Michael		Geocode
6	DEPTH, water	Depth water	m	Seidel, Michael		Geocode
7	Salinity	Sal		Wollschläger, Jochen	CTD/Rosette (CTD-RO)
8	Nitrogen oxide	NOx	µmol/l	Beck, Melanie	Spectrophotometer, Thermo Fisher Scientific, Multiskan GO Microplate	Empty cell means <LOD
9	Nitrate	[NO3]-	µmol/l	Beck, Melanie	Spectrophotometer, Thermo Fisher Scientific, Multiskan GO Microplate
10	Nitrite	[NO2]-	µmol/l	Beck, Melanie	Spectrophotometer, Thermo Fisher Scientific, Multiskan GO Microplate	Empty cell means <LOD
11	Silicate	Si(OH)4	µmol/l	Beck, Melanie	Spectrophotometer, Thermo Fisher Scientific, Multiskan GO Microplate
12	Chlorophyll a	Chl a	µg/l	Wollschläger, Jochen	Submersible fluorometer, Turner Designs, SCUFA II
13	Suspended particulate matter	SPM	mg/l	Wollschläger, Jochen	Submersible fluorometer, Turner Designs, SCUFA II
14	Carbon, organic, dissolved	DOC	µmol/l	Seidel, Michael	Shimadzu TOC-VCPH total organic carbon analyzer
15	Hydrogen/Carbon ratio	H/C		Seidel, Michael	Electrospray ionisation Fourier-transform ion cyclotron resonance mass spectrometry (ESI-FT-ICR-MS), solariX XR, Bruker Daltonik GmbH mounted to a 15 Tesla superconducting magnet, Bruker Biospin (ESI-FT-ICR-MS)
16	Oxygen/Carbon ratio	O/C		Seidel, Michael	Electrospray ionisation Fourier-transform ion cyclotron resonance mass spectrometry (ESI-FT-ICR-MS), solariX XR, Bruker Daltonik GmbH mounted to a 15 Tesla superconducting magnet, Bruker Biospin (ESI-FT-ICR-MS)
17	Aromaticity index, modified	AI mod		Seidel, Michael	Electrospray ionisation Fourier-transform ion cyclotron resonance mass spectrometry (ESI-FT-ICR-MS), solariX XR, Bruker Daltonik GmbH mounted to a 15 Tesla superconducting magnet, Bruker Biospin (ESI-FT-ICR-MS)
18	Manganese	Mn	nmol/l	Dellwig, Olaf	Quatrupole inductively coupled mass spectometry (Q-ICP-MS, iCAP Q), Thermo Fisher Scientific); mounted to a seaFAST pico pre-concentration, Element Scientific
19	Lanthanum	La	pmol/l	Dellwig, Olaf	Quatrupole inductively coupled mass spectometry (Q-ICP-MS, iCAP Q), Thermo Fisher Scientific); mounted to a seaFAST pico pre-concentration, Element Scientific
20	Cerium	Ce	pmol/l	Dellwig, Olaf	Quatrupole inductively coupled mass spectometry (Q-ICP-MS, iCAP Q), Thermo Fisher Scientific); mounted to a seaFAST pico pre-concentration, Element Scientific
21	Praseodymium	Pr	pmol/l	Dellwig, Olaf	Quatrupole inductively coupled mass spectometry (Q-ICP-MS, iCAP Q), Thermo Fisher Scientific); mounted to a seaFAST pico pre-concentration, Element Scientific
22	Neodymium	Nd	pmol/l	Dellwig, Olaf	Quatrupole inductively coupled mass spectometry (Q-ICP-MS, iCAP Q), Thermo Fisher Scientific); mounted to a seaFAST pico pre-concentration, Element Scientific
23	Samarium	Sm	pmol/l	Dellwig, Olaf	Quatrupole inductively coupled mass spectometry (Q-ICP-MS, iCAP Q), Thermo Fisher Scientific); mounted to a seaFAST pico pre-concentration, Element Scientific
24	Europium	Eu	pmol/l	Dellwig, Olaf	Quatrupole inductively coupled mass spectometry (Q-ICP-MS, iCAP Q), Thermo Fisher Scientific); mounted to a seaFAST pico pre-concentration, Element Scientific
25	Gadolinium	Gd	pmol/l	Dellwig, Olaf	Quatrupole inductively coupled mass spectometry (Q-ICP-MS, iCAP Q), Thermo Fisher Scientific); mounted to a seaFAST pico pre-concentration, Element Scientific
26	Terbium	Tb	pmol/l	Dellwig, Olaf	Quatrupole inductively coupled mass spectometry (Q-ICP-MS, iCAP Q), Thermo Fisher Scientific); mounted to a seaFAST pico pre-concentration, Element Scientific
27	Dysprosium	Dy	pmol/l	Dellwig, Olaf	Quatrupole inductively coupled mass spectometry (Q-ICP-MS, iCAP Q), Thermo Fisher Scientific); mounted to a seaFAST pico pre-concentration, Element Scientific
28	Holmium	Ho	pmol/l	Dellwig, Olaf	Quatrupole inductively coupled mass spectometry (Q-ICP-MS, iCAP Q), Thermo Fisher Scientific); mounted to a seaFAST pico pre-concentration, Element Scientific
29	Impedance, specific	Impedance	kg/cm²/s	Dellwig, Olaf	Quatrupole inductively coupled mass spectometry (Q-ICP-MS, iCAP Q), Thermo Fisher Scientific); mounted to a seaFAST pico pre-concentration, Element Scientific
30	Thulium	Tm	pmol/l	Dellwig, Olaf	Quatrupole inductively coupled mass spectometry (Q-ICP-MS, iCAP Q), Thermo Fisher Scientific); mounted to a seaFAST pico pre-concentration, Element Scientific
31	Ytterbium	Yb	pmol/l	Dellwig, Olaf	Quatrupole inductively coupled mass spectometry (Q-ICP-MS, iCAP Q), Thermo Fisher Scientific); mounted to a seaFAST pico pre-concentration, Element Scientific
32	Lutetium	Lu	pmol/l	Dellwig, Olaf	Quatrupole inductively coupled mass spectometry (Q-ICP-MS, iCAP Q), Thermo Fisher Scientific); mounted to a seaFAST pico pre-concentration, Element Scientific
33	Light rare-earth elements	LREE	pmol/l	Mori, Corinna	Quatrupole inductively coupled mass spectometry (Q-ICP-MS, iCAP Q), Thermo Fisher Scientific); mounted to a seaFAST pico pre-concentration, Element Scientific
34	Middle rare-earth elements	MREE	pmol/l	Mori, Corinna	Quatrupole inductively coupled mass spectometry (Q-ICP-MS, iCAP Q), Thermo Fisher Scientific); mounted to a seaFAST pico pre-concentration, Element Scientific
35	Heavy rare-earth elements	HREE	pmol/l	Mori, Corinna	Quatrupole inductively coupled mass spectometry (Q-ICP-MS, iCAP Q), Thermo Fisher Scientific); mounted to a seaFAST pico pre-concentration, Element Scientific
36	Heavy rare-earth elements/light rare-earth elements ratio	HREE/LREE		Mori, Corinna	Quatrupole inductively coupled mass spectometry (Q-ICP-MS, iCAP Q), Thermo Fisher Scientific); mounted to a seaFAST pico pre-concentration, Element Scientific
37	Cerium anomaly	Ce/Ce*		Mori, Corinna	Quatrupole inductively coupled mass spectometry (Q-ICP-MS, iCAP Q), Thermo Fisher Scientific); mounted to a seaFAST pico pre-concentration, Element Scientific
38	Samarium anomaly	Sm/Sm*		Mori, Corinna	Quatrupole inductively coupled mass spectometry (Q-ICP-MS, iCAP Q), Thermo Fisher Scientific); mounted to a seaFAST pico pre-concentration, Element Scientific
39	Gadolinium anomaly	Gd/Gd*		Mori, Corinna	Quatrupole inductively coupled mass spectometry (Q-ICP-MS, iCAP Q), Thermo Fisher Scientific); mounted to a seaFAST pico pre-concentration, Element Scientific
40	Samarium natural	Sm nat	pmol/l	Mori, Corinna	Quatrupole inductively coupled mass spectometry (Q-ICP-MS, iCAP Q), Thermo Fisher Scientific); mounted to a seaFAST pico pre-concentration, Element Scientific
41	Samarium anthropogenic	Sm anth	pmol/l	Mori, Corinna	Quatrupole inductively coupled mass spectometry (Q-ICP-MS, iCAP Q), Thermo Fisher Scientific); mounted to a seaFAST pico pre-concentration, Element Scientific
42	Gadolinium natural	Gd nat	pmol/l	Mori, Corinna	Quatrupole inductively coupled mass spectometry (Q-ICP-MS, iCAP Q), Thermo Fisher Scientific); mounted to a seaFAST pico pre-concentration, Element Scientific
43	Gadolinium anthropogenic	Gd anth	pmol/l	Mori, Corinna	Quatrupole inductively coupled mass spectometry (Q-ICP-MS, iCAP Q), Thermo Fisher Scientific); mounted to a seaFAST pico pre-concentration, Element Scientific
44	Comment	Comment		Mori, Corinna

License:

Creative Commons Attribution 4.0 International (CC-BY-4.0)

Status:

Curation Level: Enhanced curation (CurationLevelC)

Size:

2932 data points

Data

Download dataset as tab-delimited text — use the following character encoding:

1 Event	2 Station	3 Date/Time	4 Latitude	5 Longitude	6 Depth water [m]	7 Sal	8 NOx [µmol/l]	9 [NO3]- [µmol/l]	10 [NO2]- [µmol/l]	11 Si(OH)4 [µmol/l]	12 Chl a [µg/l]	13 SPM [mg/l]	14 DOC [µmol/l]	15 H/C	16 O/C	17 AI mod	18 Mn [nmol/l]	19 La [pmol/l]	20 Ce [pmol/l]	21 Pr [pmol/l]	22 Nd [pmol/l]	23 Sm [pmol/l]	24 Eu [pmol/l]	25 Gd [pmol/l]	26 Tb [pmol/l]	27 Dy [pmol/l]	28 Ho [pmol/l]	29 Impedance [kg/cm²/s]	30 Tm [pmol/l]	31 Yb [pmol/l]	32 Lu [pmol/l]	33 LREE [pmol/l]	34 MREE [pmol/l]	35 HREE [pmol/l]	36 HREE/LREE	37 Ce/Ce*	38 Sm/Sm*	39 Gd/Gd*	40 Sm nat [pmol/l]	41 Sm anth [pmol/l]	42 Gd nat [pmol/l]	43 Gd anth [pmol/l]	44 Comment
HE527_1-1	WS01	2019-03-19T09:45:00	53.522	8.560	5.0	5.7	258.9	257.00	1.900	143.000			537.796	1.122	0.481	0.203	463.653	111.75	178.76	31.87	145.92	50.16	8.35	221.08	6.09	42.41	8.69	29.31	4.35	33.60	6.60	289.540	65.540	73.860	4.759	0.674	1.571	6.558	31.93	18.23	33.71	187.37
HE527_2-1	WS02	2019-03-19T12:20:00	53.726	8.250	5.0	26.9	57.7	55.87	1.830	28.800			190.584	1.195	0.474	0.258	40.544	74.87	59.77	10.27	45.87	17.97	2.77	99.34	2.32	15.81	3.96	13.80	2.02	14.03	2.71	131.010	24.860	32.560	4.911	0.419	1.731	8.232	10.38	7.59	12.07	87.27
HE527_3-1	WS03	2019-03-19T13:24:00	53.781	8.015	3.6	26.4	63.6	61.76	1.840	33.300	0.000	25.610	184.947	1.183	0.477	0.252	39.059	54.72	72.08	11.01	48.12	17.86	2.52	100.57	2.59	17.06	4.18	14.08	2.04	14.42	2.95	113.850	26.350	33.490	5.562	0.632	1.781	8.144	10.03	7.83	12.35	88.22
HE527_6-1	TCS.1	2019-03-20T11:19:00	53.815	7.739	5.0	30.7	26.2	25.59	0.613	3.000	11.090	35.755	123.251	1.224	0.480	0.284	15.763	49.72	51.07	8.89	41.22	11.81	2.16	80.21	1.73	15.11	3.74	12.04	1.61	11.96	2.13	99.830	22.740	27.740	5.065	0.500	1.382	8.750	8.55	3.26	9.17	71.04
HE527_11-1	TCS.2	2019-03-20T18:05:00	53.817	7.741	5.0	30.6	26.9	26.28	0.622	3.110	2.216	1.845	109.372	1.211	0.487	0.283	7.996	40.03	35.91	8.02	31.84	10.87	1.44	68.89	1.69	12.94	3.08	11.30	1.41	10.40	1.78	79.890	19.150	24.890	5.275	0.453	1.795	9.033	6.06	4.81	7.63	61.26
HE527_15-1	TCS.3	2019-03-21T00:12:00	53.816	7.737	5.0	30.6	27.4	26.78	0.619	4.000	5.306	8.756	111.001	1.204	0.485	0.290	14.276	44.22	38.15	7.65	31.62	14.16	2.28	77.63	1.87	14.35	3.54	11.51	1.57	12.61	1.74	83.490	22.040	27.430	5.673	0.421	1.731	7.922	8.18	5.98	9.80	67.83
HE527_19-1	TCS.4	2019-03-21T06:29:00	53.817	7.741	4.8	30.6	26.8	26.15	0.653	3.270	7.414	17.467	109.267	1.223	0.476	0.280	9.385	46.32	52.04	9.10	41.54	16.13	2.18	71.62	1.79	12.90	3.35	11.14	1.62	10.71	1.64	96.960	20.220	25.110	4.541	0.562	1.891	7.622	8.53	7.60	9.40	62.22
HE527_23-1	TCS.5	2019-03-21T21:42:00	53.817	7.737	5.1	30.6	26.3	25.66	0.638	3.300	15.138	40.386	110.986	1.204	0.486	0.290	11.045	41.77	41.58	8.00	35.60	10.23	1.76	71.36	1.73	12.84	3.29	12.16	1.49	10.94	1.91	85.370	19.620	26.500	5.315	0.474	1.435	8.515	7.13	3.10	8.38	62.98
HE527_27-1	TCS.6	2019-03-21T18:45:00	53.816	7.736	4.9	30.6	26.3	25.67	0.634	3.200	3.255	1.302	115.429	1.240	0.465	0.294	9.590	41.70	38.35	7.60	31.53	11.55	2.07	72.12	2.17	12.63	3.33	11.23	1.52	11.10	1.80	80.830	20.200	25.650	5.529	0.491	1.542	7.100	7.49	4.06	10.16	61.96
HE527_31-1	TCS.7	2019-03-22T00:44:00	53.816	7.736	5.0	30.6	25.8	25.14	0.662	3.240	7.306	11.909	109.073	1.208	0.486	0.288	9.729	40.53	39.47	8.11	29.88	12.10	2.10	74.67	1.66	12.49	3.34	11.08	1.45	11.91	1.87	78.520	19.590	26.310	5.800	0.519	1.625	8.400	7.45	4.65	8.89	65.78
HE527_35-1	TCS.8	2019-03-22T07:18:00	53.816	7.743	4.5	30.8	15.1	14.50	0.603	2.540	7.845	16.494	109.296	1.210	0.485	0.292	7.897	36.04	31.07	7.07	31.65	8.25	1.60	70.30	1.63	11.88	3.25	10.58	1.32	10.89	1.62	74.760	18.360	24.410	5.511	0.429	1.268	9.049	6.50	1.75	7.77	62.53
HE527_39-1	TCS.9	2019-03-22T13:09:00	53.817	7.735	4.8	30.6	25.5	24.88	0.622	2.860	3.791	6.205	110.318	1.243	0.461	0.296	10.222	41.55	36.11	7.11	30.81	13.76	2.16	71.13	1.63	13.16	2.98	10.48	1.48	10.52	1.68	79.470	19.930	24.160	5.490	0.444	1.796	8.000	7.66	6.10	8.89	62.24
HE527_5-1	TCOB.1	2019-03-20T10:10:00	53.807	7.617	4.9	30.9	25.3	24.74	0.563	2.690	8.757	26.984	107.250	1.203	0.493	0.284	13.849	44.98	42.02	8.56	35.43	10.16	1.66	70.02	1.89	11.56	3.13	10.36	1.37	11.57	1.72	88.970	18.240	25.020	4.893	0.458	1.500	8.088	6.77	3.39	8.66	61.36
HE527_7-1	TCOB.2	2019-03-20T13:10:00	53.807	7.619	4.7	30.5	28.0	27.34	0.665	4.470	18.220	62.188	122.945	1.202	0.486	0.286	11.711	43.20	44.00	9.00	38.99	14.80	1.74	70.40	1.88	12.53	3.30	10.61	1.47	10.80	2.00	91.190	19.450	24.880	4.983	0.508	2.000	8.029	7.40	7.40	8.77	61.63
HE527_10-1	TCOB.3	2019-03-20T16:50:00	53.807	7.618	5.1	29.8	34.7	33.78	0.924	8.490	9.787	33.025	132.794	1.213	0.473	0.276	47.191	44.84	44.41	9.14	36.71	13.04	2.19	76.65	1.98	15.17	3.67	13.06	1.57	13.66	2.26	90.690	23.010	30.550	5.741	0.500	1.585	7.718	8.23	4.81	9.93	66.72
HE527_12-1	TCOB.4	2019-03-20T19:39:00	53.807	7.617	5.0	30.6	26.5	25.91	0.594	3.190	2.992	3.574	109.105	1.242	0.465	0.284	13.146	43.27	36.58	8.40	28.55	13.10	2.19	65.92	1.81	12.21	3.17	10.07	1.37	10.18	1.63	80.220	19.380	23.250	5.039	0.453	1.750	7.000	7.49	5.61	9.42	56.50
HE527_14-1	TCOB.5	2019-03-20T22:24:00	53.808	7.617	5.0	31.0	24.8	24.26	0.544	2.700	1.400	0.000	102.412	1.210	0.488	0.290	10.234	43.18	33.19	7.47	28.30	12.47	2.16	70.94	1.69	11.22	3.21	10.60	1.50	10.42	2.01	78.950	18.280	24.530	5.878	0.396	1.667	7.859	7.48	4.99	9.03	61.91
HE527_16-1	TCOB.6	2019-03-21T01:53:00	53.808	7.623	5.0	30.4	27.7	27.02	0.678	4.290	15.775	47.174	112.004	1.200	0.485	0.286	15.069	46.10	45.53	8.74	37.16	12.03	2.17	73.52	1.91	12.26	3.15	11.30	1.47	11.20	2.07	92.000	19.490	26.040	5.121	0.484	1.434	7.605	8.39	3.64	9.67	63.85
HE527_18-1	TCOB.7	2019-03-21T05:00:00	53.807	7.617	5.0	30.2	28.8	28.08	0.721	4.320	28.202	89.658	114.266	1.202	0.483	0.287	14.068	44.74	46.65	8.81	35.12	11.39	2.48	72.78	1.98	13.07	3.39	11.88	1.43	11.76	1.88	88.670	20.920	26.950	5.143	0.508	1.263	6.892	9.02	2.37	10.56	62.22
HE527_20-1	TCOB.8	2019-03-21T08:18:00	53.808	7.617	4.8	30.7	26.4	25.75	0.647	3.170	15.186	43.300	108.020	1.211	0.483	0.284	13.018	43.80	39.63	8.39	34.74	14.29	1.70	63.96	1.78	12.06	3.11	11.30	1.53	10.96	2.06	86.930	18.650	25.850	5.304	0.458	2.044	7.636	6.99	7.30	8.38	55.58
HE527_22-1	TCOB.9	2019-03-21T11:07:00	53.807	7.618	4.9	30.9	24.8	24.22	0.585	2.410	17.634	49.591	102.142	1.216	0.491	0.277	9.344	42.58	39.44	8.49	28.90	11.09	1.89	65.28	1.61	10.74	3.30	10.43	1.53	11.22	1.70	79.970	17.540	24.880	5.471	0.509	1.591	7.788	6.97	4.12	8.38	56.90
HE527_24-2	TCOB.10	2019-03-21T14:40:00	53.805	7.604	5.0	30.5	27.8	27.09	0.712	4.470	21.520	64.493	114.464	1.200	0.488	0.286	12.738	42.22	44.39	8.81	33.74	14.24	2.15	71.39	1.85	13.55	3.51	10.87	1.55	11.92	2.14	84.770	21.060	26.480	5.759	0.536	1.804	7.493	7.89	6.35	9.53	61.86
HE527_26-1	TCOB.11	2019-03-21T17:10:00	53.807	7.616	5.1	30.3	28.9	28.19	0.712	4.890	15.246	41.206	117.529	1.190	0.486	0.286	15.701	83.00	48.68	9.28	38.31	13.45	2.46	73.43	1.94	14.47	3.59	12.58	1.62	11.71	1.79	130.590	22.460	27.700	3.907	0.351	1.509	7.136	8.91	4.54	10.29	63.14
HE527_28-1	TCOB.12	2019-03-21T20:23:00	53.807	7.618	5.5	30.7	26.5	25.86	0.641	2.870	2.918	0.000	108.809	1.202	0.485	0.287	10.385	40.86	36.38	7.28	35.13	14.21	1.97	71.91	1.69	11.18	3.35	11.22	1.53	10.95	2.08	83.270	18.190	25.780	5.843	0.436	1.837	8.324	7.74	6.47	8.64	63.27
HE527_30-1	TCOB.13	2019-03-21T23:08:00	53.808	7.617	5.1	30.9	24.9	24.33	0.575	2.540	5.286	5.240	104.242	1.212	0.489	0.285	7.664	37.69	34.48	7.00	28.30	10.93	2.11	67.36	1.66	11.57	3.21	10.81	1.40	10.39	1.60	72.990	18.550	24.200	5.630	0.490	1.489	7.571	7.34	3.59	8.90	58.46
HE527_32-1	TCOB.14	2019-03-22T02:16:00	53.809	7.614	4.9	30.6	27.2	26.52	0.684	3.850	22.461	65.083	113.594	1.201	0.487	0.291	11.935	43.72	38.56	7.74	35.31	13.34	2.07	74.23	1.80	13.20	3.32	11.80	1.64	11.28	1.98	86.770	20.390	26.700	5.593	0.458	1.720	8.111	7.76	5.58	9.15	65.08
HE527_34-1	TCOB.15	2019-03-22T05:43:00	53.808	7.617	5.0	30.1	30.1	29.31	0.789	5.700	19.361	55.684	126.641	1.224	0.471	0.282	26.149	45.89	47.39	9.22	39.87	12.96	2.14	74.84	1.94	15.15	3.73	11.65	1.58	12.49	2.20	94.980	22.960	27.920	5.350	0.524	1.519	7.636	8.53	4.43	9.80	65.04
HE527_36-1	TCOB.16	2019-03-22T08:47:00	53.807	7.619	5.2	30.7	26.3	25.63	0.672	2.860	11.290	27.654	120.143	1.207	0.488	0.290	9.272	64.19	78.83	9.14	40.24	11.26	1.76	69.91	1.73	14.29	3.45	11.35	1.22	10.86	2.18	113.570	21.230	25.610	4.206	0.684	1.500	8.333	7.51	3.75	8.39	61.52
HE527_38-1	TCOB.17	2019-03-22T12:00:00	53.810	7.620	5.0	30.8	25.2	24.61	0.588	2.690	12.489	28.840	110.740	1.206	0.486	0.296	8.750	42.33	36.51	7.73	34.32	13.49	2.26	69.85	1.63	12.66	2.98	10.89	1.46	11.50	1.78	84.380	19.530	25.630	5.423	0.429	1.654	7.746	8.16	5.33	9.02	60.83
HE527_8-1	TCL.1	2019-03-20T14:58:00	53.788	7.499	5.1	30.6	28.2	27.56	0.644	4.710	7.987	21.094	113.667	1.213	0.486	0.284	15.079	47.61	42.26	8.24	33.25	10.89	2.01	69.17	1.90	12.57	3.39	11.06	1.58	11.09	1.88	89.100	19.870	25.610	5.291	0.450	1.429	7.351	7.62	3.27	9.41	59.76
HE527_13-1	TCL.2	2019-03-20T20:53:00	53.788	7.501	4.8	30.9	25.8	25.22	0.582	2.930	6.753	13.423	106.475	1.212	0.484	0.284	12.575	41.76	35.94	7.65	32.02	9.99	1.52	65.79	1.52	12.48	2.93	9.98	1.11	11.63	1.60	81.430	18.450	24.320	4.961	0.436	1.600	9.088	6.24	3.75	7.24	58.55
HE527_17-1	TCL.3	2019-03-21T03:32:00	53.788	7.652	5.5	30.7	27.4	26.77	0.634	3.870	10.141	23.248	109.613	1.206	0.487	0.283	11.701	39.04	36.79	8.14	35.91	10.89	1.73	67.42	1.82	13.01	3.06	10.51	1.63	10.59	1.81	83.090	19.620	24.540	5.500	0.453	1.556	7.910	7.00	3.89	8.52	58.90
HE527_21-1	TCL.4	2019-03-21T09:40:00	53.787	7.503	4.9	30.8	27.0	26.36	0.644	3.690	14.237	37.638	111.640	1.206	0.489	0.279	17.572	42.56	40.38	8.93	36.65	12.48	2.25	71.71	1.80	15.91	3.35	11.70	1.68	11.64	2.05	88.140	23.310	27.070	5.456	0.466	1.481	7.520	8.42	4.06	9.54	62.17
HE527_25-1	TCL.5	2019-03-21T15:38:00	53.788	7.500	5.0	30.5	28.4	27.71	0.693	5.050	10.590	22.450	116.479	1.214	0.484	0.278	16.094	44.36	43.47	8.71	38.41	13.03	2.21	71.17	2.15	15.07	3.33	10.07	1.63	11.50	1.76	91.480	22.760	24.960	5.017	0.492	1.527	6.747	8.53	4.50	10.55	60.62
HE527_29-1	TCL.6	2019-03-21T21:56:00	53.787	7.500	4.8	31.0	26.1	25.52	0.582	3.640	7.945	12.805	105.369	1.227	0.478	0.284	12.080	48.86	40.29	7.54	30.66	12.25	2.05	71.05	1.81	11.91	3.37	12.29	1.56	10.60	1.88	87.060	19.140	26.330	5.396	0.450	1.660	7.750	7.38	4.87	9.17	61.88
HE527_33-1	TCL.7	2019-03-22T03:42:00	53.787	7.499	5.4	30.7	27.7	27.04	0.656	3.410	15.926	36.319	119.428	1.220	0.469	0.284	10.800	44.95	44.07	8.59	37.49	13.87	2.23	70.53	2.07	13.49	3.30	11.67	1.56	11.47	1.94	91.030	21.090	26.640	5.211	0.500	1.630	6.840	8.51	5.36	10.31	60.22
HE527_37-1	TCL.8	2019-03-22T10:07:00	53.788	7.500	5.6	30.8	26.9	26.27	0.634	3.580	14.830	35.129	109.136	1.206	0.487	0.290	12.025	40.38	41.35	8.13	35.06	11.68	1.93	66.79	1.70	14.00	3.50	11.57	1.52	11.18	1.72	83.570	21.130	25.990	5.283	0.491	1.542	7.735	7.58	4.10	8.63	58.16
HE527_42-1	ES01	2019-03-23T07:36:00	55.397	4.482	4.8	34.9		0.00	0.163	0.351	0.673	0.000	66.981	1.252	0.491	0.275	3.282	19.45	22.72	4.41	17.07	7.41	1.01	5.45	0.71	5.93	1.33	4.41	0.58	3.99	0.77	40.930	8.980	9.750	4.111	0.556	2.000	1.355	3.71	3.71	4.02	1.43
HE527_42-4	ES01.d	2019-03-23T07:36:00	55.397	4.482	30.0	34.9		0.00	0.173	0.299			68.850	1.252	0.493	0.278	3.607	21.77	26.22	4.77	21.01	7.39	1.04	5.49	0.85	6.10	1.44	4.45	0.61	4.16	0.84	47.550	9.430	10.060	3.900	0.581	1.778	1.257	4.16	3.23	4.37	1.12
HE527_43-1	ES02	2019-03-23T11:08:00	55.190	4.952	5.0	34.8		0.00		0.430	0.000	0.000	67.495	1.248	0.500	0.266	9.216	35.20	45.85	8.32	33.56	11.96	1.64	8.97	1.37	10.57	2.29	6.98	1.00	6.05	1.02	77.080	15.870	15.050	3.235	0.600	1.767	1.250	6.77	5.19	7.18	1.79
HE527_43-4	ES02.d	2019-03-23T11:08:00	55.190	4.952	30.2	34.8		0.00		0.000			66.114	1.251	0.493	0.279	8.995	35.97	45.10	8.38	33.24	10.64	1.80	9.25	1.38	9.94	2.12	6.78	0.96	6.17	1.07	77.590	15.240	14.980	3.294	0.600	1.511	1.241	7.04	3.60	7.45	1.80
HE527_44-1	ES03	2019-03-23T15:11:00	54.992	5.412	5.0	34.6		0.00	0.204	3.010	0.000	0.000	74.191	1.248	0.489	0.290	8.548	39.26	33.72	8.34	38.62	12.21	1.69	10.85	1.40	10.34	2.54	7.40	1.11	7.45	1.28	86.220	15.970	17.240	3.554	0.368	1.660	1.483	7.36	4.85	7.32	3.53
HE527_44-4	ES03.d	2019-03-23T15:22:00	54.992	5.412	20.0	34.6		0.00	0.271	3.230			71.293	1.242	0.494	0.290	8.846	38.21	33.48	8.21	33.58	12.16	1.72	10.83	1.40	9.72	2.37	7.60	1.03	7.50	1.23	80.000	15.210	17.360	3.784	0.404	1.773	1.483	6.86	5.30	7.30	3.53
HE527_45-1	ES04	2019-03-24T07:06:00	54.780	5.903	5.0	34.6		0.00	0.211	2.070	0.000	0.000	69.723	1.250	0.491	0.282	5.574	40.64	34.46	8.02	31.60	11.95	1.64	15.80	1.27	9.69	2.25	7.61	0.99	6.91	1.25	80.260	14.850	16.760	3.667	0.453	1.810	2.296	6.60	5.35	6.88	8.92	mean of duplicates for H/C, O/C and AImod
HE527_46-1	ES05	2019-03-24T10:35:00	54.570	6.390	5.5	34.7	8.0	7.76	0.211	4.720	0.000	0.000	68.727	1.252	0.488	0.291	4.773	28.32	33.62	6.35	25.44	9.90	1.40	24.34	1.25	9.30	2.26	6.82	0.90	6.39	1.13	60.110	14.210	15.240	4.250	0.525	1.829	3.918	5.41	4.49	6.21	18.13
HE527_46-6	ES05.d	2019-03-24T13:09:00	54.570	6.390	30.4	34.7	7.9	7.69	0.252	4.290			72.144	1.243	0.490	0.292	4.371	29.35	29.25	6.21	25.95	10.10	1.24	8.97	1.28	8.78	2.17	7.10	0.99	6.49	1.23	61.510	13.470	15.810	4.667	0.525	1.939	1.458	5.21	4.89	6.15	2.82
HE527_47-1	ES06	2019-03-24T13:09:00	54.355	6.899	5.5	33.8	7.3	7.03	0.280	0.717	0.000	0.000	73.127	1.241	0.487	0.296	5.948	36.20	40.19	6.84	29.68	10.55	1.60	30.06	1.62	11.04	2.67	8.29	1.14	7.69	1.42	72.720	16.930	18.540	4.587	0.562	1.700	3.869	6.21	4.34	7.77	22.29
HE527_47-4	ES06.d	2019-03-24T13:37:00	54.355	6.899	31.8	34.7		0.00	0.211	0.286			66.968	1.246	0.489	0.295	6.073	38.23	50.46	7.86	32.64	10.85	1.83	12.46	1.50	10.22	2.42	7.51	0.94	7.02	1.28	78.730	15.970	16.750	3.720	0.647	1.556	1.581	6.98	3.88	7.88	4.58
HE527_48-1	Elbe01	2019-03-26T09:13:00	53.969	8.495	4.8	20.8	131.4	129.50	1.900	63.000	22.633	88.721	231.161	1.188	0.481	0.234	110.493	56.46	59.63	12.55	51.53	18.43	2.94	157.92	2.56	20.36	5.03	16.10	2.32	18.08	3.91	120.540	30.890	40.410	6.513	0.500	1.616	12.058	11.40	7.03	13.10	144.82
HE527_49-1	Elbe02	2019-03-26T11:25:00	53.880	8.721	5.0	7.3	280.5	279.20	1.300	144.500	50.757	226.738	394.554	1.161	0.480	0.214	136.522	79.81	109.12	24.40	108.06	50.92	5.14	269.00	4.74	30.95	6.48	21.03	3.59	26.03	4.74	212.270	47.310	55.390	4.894	0.554	2.397	11.376	21.24	29.68	23.65	245.35
HE527_50-1	Elbe03	2019-03-26T13:13:00	53.859	9.001	5.2	1.2	335.0	334.78	0.220	170.000	65.896	321.813	425.868	1.173	0.470	0.188	82.366	72.49	96.79	26.28	108.57	61.61	5.76	322.12	4.68	32.41	6.53	23.09	3.62	25.50	4.84	207.340	49.380	57.050	4.915	0.541	2.699	13.062	22.83	38.78	24.66	297.46
HE527_51-1	NF-S01	2019-03-27T07:03:00	54.284	8.390	5.4	28.6	48.8	46.57	2.230	21.600	15.465	59.569	153.827	1.188	0.486	0.286	6.754	47.99	48.33	9.70	42.44	19.87	1.88	71.65	1.92	13.42	3.64	12.07	2.03	14.02	3.02	100.130	20.860	31.140	6.328	0.493	2.462	7.726	8.07	11.80	9.27	62.38
HE527_52-1	NF-S02	2019-03-27T08:31:00	54.283	8.250	5.1	28.5	48.5	46.35	2.150	22.000	8.600	29.960	153.173	1.192	0.485	0.286	5.342	42.95	33.80	7.83	35.34	13.19	2.29	74.65	1.89	13.98	3.56	12.02	1.89	12.53	2.73	86.120	21.720	29.170	6.833	0.421	1.556	7.538	8.48	4.71	9.90	64.75
HE527_53-1	NF-S03	2019-03-27T10:30:00	54.281	8.102	5.0	29.1	43.5	41.69	1.810	16.700	5.131	15.093	136.491	1.194	0.485	0.281	9.902	56.57	53.29	10.12	44.98	15.05	2.54	83.33	2.14	16.78	3.61	12.64	1.94	12.72	2.60	111.670	25.070	29.900	5.304	0.486	1.524	7.540	9.88	5.17	11.05	72.28
HE527_54-1	NF-S04	2019-03-27T11:56:00	54.282	7.953	5.4	30.0	34.6	33.16	1.440	12.700	2.700	5.509	124.426	1.200	0.485	0.283	9.485	44.12	36.08	9.15	40.44	14.91	1.53	84.88	1.74	14.61	3.87	12.61	1.84	13.36	2.83	93.710	21.750	30.640	6.317	0.387	2.133	10.603	6.99	7.92	8.01	76.87
HE527_55-1	NF-S05	2019-03-27T13:54:00	54.283	7.798	5.3	30.3	32.8	31.31	1.490	11.700	2.057	3.489	120.955	1.208	0.483	0.285	8.657	38.62	32.98	6.56	31.05	11.19	2.13	77.79	1.57	13.87	3.54	10.40	1.64	11.94	2.13	76.230	21.110	26.110	6.702	0.412	1.469	9.000	7.62	3.57	8.64	69.15
HE527_56-1	NF-S06	2019-03-27T15:38:00	54.283	7.635	5.2	31.6	20.7	19.68	1.020	7.460	1.819	1.377	103.753	1.218	0.484	0.297	7.204	42.79	34.63	7.72	33.99	12.20	1.55	65.93	1.61	12.89	3.21	11.21	1.43	10.93	2.09	84.500	19.260	25.660	5.635	0.429	1.857	8.492	6.57	5.63	7.76	58.17
HE527_57-1	NF-S07	2019-03-27T17:09:00	54.284	7.488	5.0	32.5	13.2	12.33	0.872	6.480	1.464	0.000	92.574	1.229	0.496	0.290	8.560	38.41	30.34	7.19	36.45	10.71	1.89	56.42	1.63	12.79	3.24	9.47	1.43	10.06	1.85	82.050	19.550	22.810	5.460	0.396	1.417	6.727	7.56	3.15	8.39	48.03
HE527_58-1	NF-T01	2019-03-28T07:01:00	54.767	8.147	5.0	29.2	47.2	45.64	1.560	23.000	13.227	50.397	140.142	1.198	0.485	0.276	4.358	43.06	40.88	9.12	40.51	15.42	2.05	81.77	1.94	13.94	3.37	11.60	1.76	13.74	2.62	92.690	21.300	29.720	6.203	0.450	1.849	8.587	8.34	7.08	9.52	72.25
HE527_59-1	NF-T02	2019-03-28T08:24:00	54.765	8.005	5.1	29.7	42.1	40.44	1.660	21.400	7.501	25.000	134.480	1.205	0.483	0.279	5.716	51.76	44.61	9.28	39.31	12.52	1.71	76.54	2.12	14.63	3.68	11.59	1.97	12.64	2.60	100.350	22.140	28.800	5.919	0.448	1.702	8.135	7.36	5.16	9.41	67.13
HE527_60-1	NF-T03	2019-03-28T09:48:00	54.765	7.856	5.3	30.4	35.3	33.53	1.770	19.100	5.064	13.988	133.297	1.210	0.484	0.280	6.990	53.56	41.52	8.51	40.27	11.34	2.07	78.04	2.04	14.34	3.72	12.56	1.92	12.25	2.53	102.340	22.170	29.260	5.667	0.386	1.358	7.974	8.35	2.99	9.79	68.25
HE527_61-1	NF-T04	2019-03-28T11:18:00	54.764	7.714	5.2	31.3	24.0	22.53	1.470	13.900	3.420	6.565	113.499	1.215	0.485	0.296	5.676	39.88	30.69	6.98	30.66	13.58	2.36	61.31	1.96	14.04	3.45	11.00	1.66	11.11	1.98	77.520	21.810	25.750	6.292	0.404	1.654	6.025	8.21	5.37	10.18	51.13
HE527_62-1	NF-T05	2019-03-28T12:58:00	54.765	7.570	4.8	32.2	15.3	14.19	1.110	9.080	2.405	2.222	102.664	1.228	0.482	0.301	6.301	47.14	32.88	6.89	29.36	11.78	1.72	56.83	1.87	12.16	3.08	10.02	1.51	10.03	2.00	83.390	18.830	23.560	5.588	0.362	1.810	6.559	6.51	5.27	8.66	48.17
HE527_63-1	NF-T06	2019-03-28T14:42:00	54.767	7.419	5.1	33.3	7.2	6.61	0.575	1.040	2.924	1.119	91.676	1.244	0.480	0.308	7.433	57.38	79.36	11.09	59.98	14.63	4.15	45.63	3.65	15.76	4.64	10.95		10.62		128.450	28.200		1.150	0.643	0.989	2.452	14.79	0.00	18.61	27.02
HE527_64-1	D06	2019-03-29T07:06:00	54.238	7.246	4.9	33.2	5.7	5.47	0.185	0.717	0.000	0.000	77.700	1.238	0.483	0.300	9.159	34.99	41.81	7.02	32.00	10.02	1.95	29.83	1.57	10.71	2.67	8.31	1.21	7.43	1.35	74.010	16.900	18.300	4.426	0.551	1.362	3.545	7.36	2.66	8.41	21.42
HE527_64-4	D06.d	2019-03-29T07:06:00	54.238	7.246	33.5	34.0	9.4	9.15	0.243				78.156	1.245	0.484	0.296	8.249	44.22	54.06	7.20	31.84	11.11	2.00	72.45	1.82	11.49	3.05	9.19	1.37	8.84	1.46	83.260	18.360	20.860	4.627	0.632	1.532	8.028	7.25	3.86	9.02	63.43
HE527_65-1	D05	2019-03-29T09:13:00	54.116	7.311	5.0	32.7	14.5	13.91	0.591	3.200	0.000	0.000	86.474	1.239	0.479	0.304	7.401	59.18	39.43	7.92	36.37	10.57	1.80	53.61	1.73	11.20	3.04	9.84	1.38	9.37	1.76	103.470	17.770	22.350	4.177	0.370	1.478	6.394	7.15	3.42	8.38	45.23
HE527_66-1	D04	2019-03-29T11:12:00	54.006	7.368	5.0	32.6	12.5	11.71	0.789	5.930	0.458	0.000	98.899	1.233	0.485	0.308	5.160	36.06	36.59	7.29	31.78	11.30	1.72	57.77	1.59	12.27	3.09	9.76	1.57	9.83	1.62	75.130	18.670	22.780	5.638	0.490	1.674	7.323	6.75	4.55	7.89	49.88
HE527_67-1	D03	2019-03-29T13:05:00	53.937	7.414	5.0	32.3	16.8	16.31	0.488	0.731	0.000	0.000	88.404	1.225	0.491	0.302	6.569	36.94	34.47	6.96	32.35	12.70	2.13	60.39	1.58	12.97	2.93	10.10	1.46	9.92	1.51	76.250	19.610	22.990	5.271	0.471	1.673	6.971	7.59	5.11	8.66	51.73
HE527_68-1	D02	2019-03-29T14:53:00	53.859	7.463	5.0	31.6	18.9	18.48	0.419		0.000	0.000	95.485	1.219	0.486	0.297	6.102	40.39	49.44	8.14	33.75	11.47	2.13	74.07	1.67	12.02	3.14	10.28	1.43	9.95	1.75	82.280	18.960	23.410	5.096	0.611	1.480	8.314	7.75	3.72	8.91	65.16
HE527_69-2	D01	2019-03-29T17:43:00	53.789	7.497	4.8	31.1	22.2	21.69	0.510	0.534	2.496	3.980	110.847	1.207	0.485	0.289	10.267	44.69	47.25	7.97	39.00	15.45	2.06	68.67	1.92	13.94	3.62	12.35	1.69	12.15	1.93	91.660	21.540	28.120	5.421	0.541	1.885	7.200	8.20	7.25	9.54	59.13
HE527_70-1	Ems01	2019-03-30T07:08:00	53.550	6.682	5.4	29.0	40.1	39.18	0.924	10.600	6.547	18.060	184.308	1.143	0.498	0.272	14.750	49.96	54.79	10.05	41.11	14.18	2.26	80.63	1.94	15.12	3.75	12.68	2.12	12.62	2.70	101.120	23.070	30.120	5.969	0.545	1.607	8.128	8.82	5.36	9.92	70.71
HE527_70-1	Ems01.d	2019-03-30T07:08:00	53.550	6.682	18.1	29.7	45.7	44.72	0.976	13.700			166.796	1.157	0.496	0.269	17.695	59.69	49.21	8.68	38.71	12.97	2.18	68.24	1.91	15.36	3.76	12.35	1.79	12.45	2.51	107.080	23.210	29.100	5.400	0.440	1.556	7.053	8.34	4.63	9.68	58.56
HE527_71-1	Ems02	2019-03-30T09:00:00	53.490	6.799	4.8	24.5	108.9	106.75	2.150	42.300	11.062	39.269	340.923	1.110	0.496	0.245	28.466	71.07	76.72	14.23	61.99	20.88	3.82	105.39	2.95	21.64	5.15	17.22	2.83	19.26	3.73	147.290	33.560	43.040	5.763	0.526	1.473	6.624	14.18	6.70	15.91	89.48
HE527_72-1	Ems03	2019-03-20T10:44:00	53.413	6.946	4.6	17.2	213.6	210.85	2.750	84.700	19.307	74.211	609.243	1.079	0.501	0.223	68.197	79.20	96.94	19.39	92.97	29.28	5.94	127.95	4.56	34.26	7.57	25.70	4.09	30.68	5.99	191.560	52.330	66.460	6.780	0.550	1.343	5.186	21.80	7.48	24.67	103.28
HE527_73-1	Ems04	2019-03-20T12:18:00	53.341	6.993	5.5	13.2	274.5	272.16	2.340	112.000	36.631	154.531	759.802	1.091	0.490	0.212	63.253	113.57	146.77	32.09	143.77	61.14	8.79	151.73	6.13	44.15	9.67	33.69	5.26	41.26	8.07	289.430	68.740	88.280	5.776	0.553	1.858	4.374	32.91	28.23	34.69	117.04
HE527_75-1	Y	2019-03-20T17:21:00	53.863	6.361	5.2	34.7		0.00	0.575		0.000	0.921	72.600	1.244	0.488	0.295	6.133	39.29	48.17	6.47	34.38	11.78	1.94	13.95	1.43	10.09	2.48	7.26	1.07	6.79	1.10	80.140	15.940	16.220	3.694	0.611	1.617	1.803	7.29	4.50	7.74	6.21	mean of duplicates for H/C, O/C and AImod
HE527_76-1	HEL	2019-03-31T03:57:00	54.064	7.846	3.9	30.5	29.0	26.45	2.550	7.320	0.817	4.109	113.340	1.210	0.485	0.286	11.349	47.98	45.29	9.16	43.95	13.82	2.57	86.51	2.18	16.13	4.34	15.05	2.26	15.01	2.47	101.090	25.220	34.790	6.403	0.462	1.419	7.727	9.74	4.08	11.20	75.31	mean of duplicates for H/C, O/C and AImod